Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “cost function”

Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 1,747 records · Page 97

Turbulence-parameter estimation for current-energy converters using surrogate model optimization

Surrogate models maximize information utility by building predictive models in place of computational or experimentally expensive model runs. Marine hydrokinetic current energy converters require large-domain simulations to estimate array efficiencies and environmental impacts. Meso-scale models typically represent turbines as actuator discs that act as momentum sinks and sources of turbulence and its dissipation. An OpenFOAM model was developed where actuator disc k-ε turbulence was characterized using an approach developed for flows through vegetative canopies. Turbine-wake data from laboratory flume experiments collected at two influent turbulence intensities were used to calibrate parameters in the turbulence-source terms in the k-ε equations. Additionally, parameter influences on longitudinal wake profiles were estimated using Gaussian process regression with subsequent optimization minimizing the objective function within 3.1% of those obtained using the full model representation, but for 74% of the computational cost (far fewer model runs). This framework facilitates more efficient parameterization of the turbulence-source equations using turbine-wake data.

16 TIDAL AND WAVE POWER↗

Convergent Protocols for Computing Protein–Ligand Interaction Energies Using Fragment-Based Quantum Chemistry

Fragment-based quantum chemistry methods offer a way to sidestep the steep nonlinear scaling of electronic structure calculations so that large molecular systems can be investigated using high-level methods. Here, we use fragmentation to compute protein–ligand interaction energies in systems with several thousand atoms, using a new software platform for managing fragment-based calculations that implements a screened many-body expansion. Convergence tests using a minimal-basis semiempirical method (HF-3c) indicate that two-body calculations, with single-residue fragments and simple hydrogen caps, are sufficient to reproduce interaction energies obtained using conventional supramolecular electronic structure calculations, to within 1 kcal/mol at about 1% of the computational cost. We also demonstrate that the HF-3c results are illustrative of trends obtained with density functional theory in basis sets up to augmented quadruple-ζ quality. Strategic deployment of fragmentation facilitates the use of converged biomolecular model systems alongside high-quality electronic structure methods and basis sets, bringing ab initio quantum chemistry to systems of hitherto unimaginable size. This will be useful for generation of high-quality training data for machine learning applications.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

An active learning framework for the rapid assessment of galvanic corrosion

The current present in a galvanic couple can define its resistance or susceptibility to corrosion. However, as the current is dependent upon environmental, material, and geometrical parameters it is experimentally costly to measure. To reduce these costs, Finite Element (FE) simulations can be used to assess the cathodic current but also require experimental inputs to define boundary conditions. Due to these challenges, it is crucial to accelerate predictions and accurately predict the current output for different environments and geometries representative of in-service conditions. Machine learned surrogate models provides a means to accelerate corrosion predictions. However, a one-time cost is incurred in procuring the simulation and experimental dataset necessary to calibrate the surrogate model. Therefore, an active learning protocol is developed through calibration of a low-cost surrogate model for the cathodic current of an exemplar galvanic couple (AA7075-SS304) as a function of environmental and geometric parameters. The surrogate model is calibrated on a dataset of FE simulations, and calculates an acquisition function that identifies specific additional inputs with the maximum potential to improve the current predictions. This is accomplished through a staggered workflow that not only improves and refines prediction, but identifies the points at which the most information is gained, thus enabling expansion to a larger parameter space. The protocols developed and demonstrated in this work provide a powerful tool for screening various forms of corrosion under in-service conditions.

36 MATERIALS SCIENCE↗

Improving MPI Collective I/O for High Volume Non-Contiguous Requests With Intra-Node Aggregation

Two-phase I/O is a well-known strategy for implementing collective MPI-IO functions. It redistributes I/O requests among the calling processes into a form that minimizes the file access costs. As modern parallel computers continue to grow into the exascale era, the communication cost of such request redistribution can quickly overwhelm collective I/O performance. In this study, this effect has been observed from parallel jobs that run on multiple compute nodes with a high count of MPI processes on each node. Furthermore, to reduce the communication cost, we present a new design for collective I/O by adding an extra communication layer that performs request aggregation among processes within the same compute nodes. This approach can significantly reduce inter-node communication contention when redistributing the I/O requests. We evaluate the performance and compare it with the original two-phase I/O on Cray XC40 parallel computers (Theta and Cori) with Intel KNL and Haswell processors. Using I/O patterns from two large-scale production applications and an I/O benchmark, we show our proposed method effectively reduces the communication cost and hence maintains the scalability for a large number of processes.

97 MATHEMATICS AND COMPUTING↗

Module D-PR Fuel Fabrication Preface to the D-Modules

Generic Technical Factors Affecting Fuel Fabrication. Many in-reactor physical, chemical, metallurgical, mechanical, thermodynamic, and nucleonic factors influence the design and functionality of nuclear fuel. Detailed discussion of these technical factors is beyond the scope of this cost-oriented preface document; however, the following three references are suggested for a more comprehensive discussion of fuel design requirements for both commercial and special use (military and remote location) reactors: IAEA-TECDOC-1686 (IAEA 2012), the World Nuclear Association webpage “Nuclear Fuel and its Fabrication (WNA 2020a), and INL/EXT-20-54641 (Mariani 2020). To aid the reader’s understanding of how design affects life cycle costs, a few technical factors are also briefly discussed in the sections below.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

PHASM: A Toolkit for Creating AI Surrogate Models within Legacy Codebases

PHASM (“Parallel Hardware viA Surrogate Models”) is a software toolkit for creating AI-based surrogate models of scientific code. AI-based surrogate models are widely used for creating fast and inverse simulations. PHASM anticipates an additional future use case: adapting legacy code to modern hardware. While data centers are investing in heterogeneous hardware such as GPUs and FPGAs, many established scientific codebases remain unable to take advantage of the hardware’s higher parallelism without undergoing a costly rewrite. An alternative is to train a AI-based surrogate model to mimic computationally intensive functions in the code, and run the surrogate instead. PHASM formalizes a development lifecycle for such surrogate models, including discovering functions amenable to replacement with a surrogate model, predicting the resulting performance, identifying the function’s space of inputs and outputs, binding the model to the code, and managing model versions. A suite of software tools for facilitating these steps was written and validated against a set of model problems.

97 MATHEMATICS AND COMPUTING↗

Enabling Production of Algal Biofuels by Techno-Economic Optimization of Co-Product Suites

Recent techno-economic analysis (TEA) has underscored that for algal biofuels to be cost competitive with petroleum fuels, co-products are necessary to offset the cost of fuel production. The co-product suite must scale with fuel production while also maximizing value from the non-fuel precursor components. The co-product suite also depends on algal biomass composition, which is highly dynamic and depends on environmental conditions during cultivation. Intentional shifts in composition during cultivation are often associated with reduced biomass productivity, which can increase feedstock production costs for the algae-based biorefinery. The optimal algae-based biorefinery configuration is thus a function of many factors. We have found that comprehensive TEA, which requires the construction of process models with detailed mass and energy balances, along with a complete accounting of capital and operating expenditures for a commercial-scale production facility, provides invaluable insight into the viability of a proposed biorefinery configuration. This insight is reflected in improved viability for one biorefining approach that we have developed over the last 10 years, namely, the Combined Algal Processing (CAP) approach. This approach fractionates algal biomass into carbohydrate-, lipid-, and protein-rich fractions, and tailors upgrading chemistry to the composition of each fraction. In particular, transitioning from valorization of only the lipids to a co-product suite from multiple components of high-carbohydrate algal biomass can reduce the minimum fuel selling price (MFSP) from more than $8/gallon of gasoline equivalent (GGE) to $2.50/GGE. This paper summarizes that progress and discusses several surprising implications in this optimization approach.

09 BIOMASS FUELS↗

Direct Recycling R&D at the ReCell Center

The expected rapid growth in electric vehicle deployment will inevitably be followed by a corresponding rise in the supply of end-of-life vehicles and their lithium-ion batteries (LIBs). The batteries may be reused, but will eventually be spent and provide a potential domestic resource that can help supply materials for future battery production. However, commercial recycling processes depend on profits from recovery of cobalt, use of which is being reduced in new cathode chemistries. The U.S. Department of Energy, therefore, established the ReCell Center in early 2019 to develop robust LIB recycling technology that would be economical even for batteries that contain no cobalt. The central feature of the technology is recovery of the cathode material with its unique crystalline cathode morphology intact in order to retain its value and functionality. Other materials are recovered as well in order to maximize revenues and minimize waste-handling costs. Analysis and modeling serve to evaluate and compare process options so that we can identify those that will be most economical while still minimizing energy use and environmental impacts. This paper provides background and describes highlights of the center’s first 2 years of operation.

Gaines, Linda (ORCID:0000000237263387)↗

Information transfer satellite concept study. Volume 1: Summary

A wide range of information transfer demands were identified and analyzed. They were then combined into an appropriate set of requirements for satellite communication services. In this process the demands were ranked and combined into single and multipurpose satellite systems. A detailed analysis was performed on each satellite system to determine: total system cost, including both ground and space segments; sensitivities of the systems to various system tradeoffs; and forcing functions which control the system variations. A listing of candidate missions for detailed study is presented, along with a description of the conceptual system design and an identification of the technology developments required to bring these systems to fruition.

Bergin, P.↗

Table look-up approach to pattern recognition.

The table look-up approach is based on prestoring in fast, random-access, core memory the desired answer (e.g., crop-type) for all combinations of multispectral scanner outputs from selected channels. Specifically, each set of measurements from a given point on the ground is interpreted as that address in core memory where the answer can be retrieved. Substituting the simple retrieval operation for the length y computations required by the conventional approach offers two advantages: (1) the processing time is reduced by more than an order of magnitude; (2) the multispectral scanner data can be processed by computers having minimal sophistication, complexity, and cost. These two advantages may make it possible to use an onboard computer to perform the classification function in flight.

Eppler, W. G.↗

Technology requirements for post-1985 communications satellites

The technical and functional requirements for commercial communication satellites are discussed. The need for providing quality service at an acceptable cost is emphasized. Specialized services are postulated in a needs model which forecasts future demands. This needs model is based upon 322 separately identified needs for long distance communication. It is shown that the 1985 demand for satellite communication service for a domestic region such as the United States, and surrounding sea and air lanes, may require on the order of 100,000 MHz of bandwith. This level of demand can be met by means of the presently allocated bandwidths and developing some key technologies. Suggested improvements include: (1) improving antennas so that high speed switching will be possible; (2) development of solid state transponders for 12 GHz and possibly higher frequencies; (3) development of switched or steered beam antennas with 10 db or higher gain for aircraft; and (4) continued development of improved video channel compression techniques and hardware.

Burtt, J. E.↗

An analysis of the accuracy of a parameter optimization

The numerical operations involved in a currently used optimization technique are discussed and analyzed with special attention to the numerical accuracy. Alternative methods for deriving linear system transfer functions, finding the relationships between the transfer function coefficients and the design parameters, and solving a matrix equation are presented for more accurate and cost effective solutions.

Baram, Y.↗

Civil Uses of Remotely Piloted Aircraft

The economic, technical, and environmental implications of remotely piloted vehicles (RVP) are examined. The time frame is 1980-85. Representative uses are selected; detailed functional and performance requirements are derived for RPV systems; and conceptual system designs are devised. Total system cost comparisons are made with non-RPV alternatives. The potential market demand for RPV systems is estimated. Environmental and safety requirements are examined, and legal and regulatory concerns are identified. A potential demand for 2,000-11,000 RVP systems is estimated. Typical cost savings of 25 to 35% compared to non-RPV alternatives are determined. There appear to be no environmental problems, and the safety issue appears manageable.

Aderhold, J. R.↗

Flight control electronics reliability/maintenance study

Collection and analysis of data are reported that concern the reliability and maintenance experience of flight control system electronics currently in use on passenger carrying jet aircraft. Two airlines B-747 airplane fleets were analyzed to assess the component reliability, system functional reliability, and achieved availability of the CAT II configuration flight control system. Also assessed were the costs generated by this system in the categories of spare equipment, schedule irregularity, and line and shop maintenance. The results indicate that although there is a marked difference in the geographic location and route pattern between the airlines studied, there is a close similarity in the reliability and the maintenance costs associated with the flight control electronics.

Dade, W. W.↗

Process Feasibility Study in Support of Silicon Material Task 1

Analysis of process system properties was continued for silicon source materials under consideration for producing silicon. The following property data are reported for dichlorosilane which is involved in processing operations for silicon: critical constants, vapor pressure, heat of vaporization, heat capacity, density, surface tension, thermal conductivity, heat of formation and Gibb's free energy of formation. The properties are reported as a function of temperature to permit rapid engineering usage. The preliminary economic analysis of the process is described. Cost analysis results for the process (case A-two deposition reactors and six electrolysis cells) are presented based on a preliminary process design of a plant to produce 1,000 metric tons/year of silicon. Fixed capital investment estimate for the plant is $12.47 million (1975 dollars) ($17.47 million, 1980 dollars). Product cost without profit is 8.63 $/kg of silicon (1975 dollars)(12.1 $/kg, 1980 dollars).

Li, K. Y.↗

Thorium concentrations in the lunar surface. II - Deconvolution modeling and its application to the regions of Aristarchus and Mare Smythii

The broad angular response which characterized the Apollo gamma ray spectrometer resulted in a loss of spatial resolution and some of the contrast in determining surface concentrations within lunar regions small compared to the field of view. A deconvolution technique has been developed which removes much of this instrumental effect, thereby improving both spatial resolution and accuracy at the cost of a loss in precision. Geometric models of regional thorium distribution are convoluted through the response function of the instrument to yield a predicted distribution which is compared with the observed data field for quality of fit. Application to areas which include Aristarchus and Mare Smythii confirm some geological relationships and fail to support others.

Haines, E. L.↗

The SCSTPE organic Rankine engine

The organic Rankine cycle engine under consideration for a solar thermal system being developed is described. Design parameters, method of control, performance and cost data are provided for engine power levels up to 80 kWe; efficiency is shown as a function of turbine inlet temperature in the range of 149 C to 427 C.

Boda, F. P.↗

Dynamic isolation via momentum compensation for precision instrument pointing

The concept of a momentum-compensated inertially stabilized platform (IPPADS) for carrying scientific instruments is presented, the platform's function as a mechanical diode is explained, and the implications of momentum compensation for platform pointing and cost are discussed. The equations of motion for momentum compensation in the IPPADS five-body system are derived, and the results are used to computer simulate the system under consideration with two examples.

Boussalis, D.↗